ChemSpider 2D Image | 3-Acetyl-N-(3-oxo-3-{4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl}propyl)benzenesulfonamide | C21H23F3N4O4S

3-Acetyl-N-(3-oxo-3-{4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl}propyl)benzenesulfonamide

  • Molecular FormulaC21H23F3N4O4S
  • Average mass484.492 Da
  • Monoisotopic mass484.139221 Da
  • ChemSpider ID22368591

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

3-Acetyl-N-(3-oxo-3-{4-[5-(trifluormethyl)-2-pyridinyl]-1-piperazinyl}propyl)benzolsulfonamid [German] [ACD/IUPAC Name]
3-Acetyl-N-(3-oxo-3-{4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl}propyl)benzenesulfonamide [ACD/IUPAC Name]
3-Acétyl-N-(3-oxo-3-{4-[5-(trifluorométhyl)-2-pyridinyl]-1-pipérazinyl}propyl)benzènesulfonamide [French] [ACD/IUPAC Name]
Benzenesulfonamide, 3-acetyl-N-[3-oxo-3-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]propyl]- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 686.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.6±3.0 kJ/mol
Flash Point: 368.9±34.3 °C
Index of Refraction: 1.560
Molar Refractivity: 114.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.57
ACD/LogD (pH 5.5): 1.93
ACD/BCF (pH 5.5): 12.51
ACD/KOC (pH 5.5): 143.96
ACD/LogD (pH 7.4): 2.51
ACD/BCF (pH 7.4): 47.22
ACD/KOC (pH 7.4): 543.64
Polar Surface Area: 108 Å2
Polarizability: 45.3±0.5 10-24cm3
Surface Tension: 48.9±3.0 dyne/cm
Molar Volume: 353.8±3.0 cm3

Click to predict properties on the Chemicalize site


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